SCHEMBL8720916

SCHEMBL8720916

CC(=O)OCC(COC(C)=O)Cc1ccc(N(c2ccccc2)c2ccc(C(C#N)=C(C#N)C#N)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 3/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
ACACB O00763 1/20 0.34
SLC16A3 O15427 1/20 0.33
SLC16A1 P53985 1/20 0.33
CTSB P07858 2/20 0.32
CTSL P07711 1/20 0.32
CTSK P43235 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
EPHX2 P34913 1/20 0.32
PPARG P37231 1/20 0.32
MMP8 P22894 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
NPY1R P25929 1/20 0.31
NPY2R P49146 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8722335 0.85 ALDH1A1 (0.44) KMT2AMEN1ALDH1A1PPARGMMP8
SCHEMBL6888049 0.82 MEN1 (0.43) KMT2AMEN1CTSB
SCHEMBL8722337 0.76 MEN1 (0.59) KMT2AMEN1ALDH1A1MAPK1SLC16A3
SCHEMBL6154419 0.73 ALDH1A1 (0.58) ALDH1A1LMNAPPARGMMP8
SCHEMBL15502150 0.72 THRB (0.41) KMT2AMEN1ALDH1A1PPARGMMP8
SCHEMBL18784036 0.70 MEN1 (0.51) KMT2AMEN1ALDH1A1MAPK1MAPT
SCHEMBL6890328 0.69 MEN1 (0.40) KMT2AMEN1ALDH1A1LMNAMAPK1
SCHEMBL17152711 0.69 MEN1 (0.50) KMT2AMEN1ALDH1A1
SCHEMBL14744144 0.69 MEN1 (0.46) KMT2AMEN1ALDH1A1LMNAMAPK1
SCHEMBL14744143 0.69 MEN1 (0.46) KMT2AMEN1ALDH1A1LMNAMAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0868682-A1 ELECTRO- OR OPTO-OPTICAL DEVICE STABLE IN THE 600-1600 NANOMETER WAVELENGTH RANGE Akzo Nobel N.V. (NL) 1998-10-07 EP disclosed
WO-1997023807-A1 ELECTRO- OR OPTO-OPTICAL DEVICE STABLE IN THE 600-1600 NANOMETER WAVELENGTH RANGE AKZO NOBEL N.V. (NL) 1997-07-03 WO disclosed
EP-0780722-A1 Electro-optical device stable in the 600-1600 nanometer wavelength range Akzo Nobel N.V. (NL) 1997-06-25 EP disclosed